ChemSpider 2D Image | 3-(2,5-Dihydroxy-4-methylphenyl)-4,4-dimethyl-2-cyclopenten-1-one | C14H16O3

3-(2,5-Dihydroxy-4-methylphenyl)-4,4-dimethyl-2-cyclopenten-1-one

  • Molecular FormulaC14H16O3
  • Average mass232.275 Da
  • Monoisotopic mass232.109940 Da
  • ChemSpider ID78435773

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

2-Cyclopenten-1-one, 3-(2,5-dihydroxy-4-methylphenyl)-4,4-dimethyl- [ACD/Index Name]
3-(2,5-Dihydroxy-4-methylphenyl)-4,4-dimethyl-2-cyclopenten-1-on [German] [ACD/IUPAC Name]
3-(2,5-Dihydroxy-4-methylphenyl)-4,4-dimethyl-2-cyclopenten-1-one [ACD/IUPAC Name]
3-(2,5-Dihydroxy-4-méthylphényl)-4,4-diméthyl-2-cyclopentén-1-one [French] [ACD/IUPAC Name]
Coralcuparene

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 374.5±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.6±3.0 kJ/mol
Flash Point: 194.5±24.4 °C
Index of Refraction: 1.593
Molar Refractivity: 65.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.33
ACD/LogD (pH 5.5): 2.30
ACD/BCF (pH 5.5): 33.04
ACD/KOC (pH 5.5): 425.52
ACD/LogD (pH 7.4): 2.30
ACD/BCF (pH 7.4): 33.02
ACD/KOC (pH 7.4): 425.26
Polar Surface Area: 58 Å2
Polarizability: 25.8±0.5 10-24cm3
Surface Tension: 49.0±3.0 dyne/cm
Molar Volume: 192.2±3.0 cm3

Click to predict properties on the Chemicalize site


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